SCHEMBL5186247

SCHEMBL5186247

CCCN(CCC)C(=O)Cn1c2ccccc2c2ccc(OC)cc21

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSPO P30536 16/20 0.63
LMNA P02545 2/20 0.52
HPGD P15428 1/20 0.52
PSEN1 P49768 1/20 0.47
PSEN2 P49810 1/20 0.47
APH1B Q8WW43 1/20 0.47
NCSTN Q92542 1/20 0.47
APH1A Q96BI3 1/20 0.47
PSENEN Q9NZ42 1/20 0.47
GLA P06280 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5186257 0.96 TSPO (0.58) TSPOLMNAHPGDPSEN1PSEN2
SCHEMBL5185075 0.93 TSPO (0.60) TSPOPSEN1PSEN2APH1BNCSTN
SCHEMBL5185433 0.93 TSPO (0.55) TSPOLMNAHPGDPSEN1PSEN2
SCHEMBL5187781 0.90 TSPO (0.54) TSPOLMNAHPGDPSEN1PSEN2
SCHEMBL5187768 0.89 TSPO (0.64) TSPOHPGDPSEN1PSEN2APH1B
SCHEMBL5185092 0.87 TSPO (0.56) TSPOHPGD
SCHEMBL5186270 0.85 TSPO (0.58) TSPOHPGD
SCHEMBL5186244 0.85 TSPO (0.62) TSPO
SCHEMBL5186927 0.85 TSPO (0.62) TSPO
SCHEMBL5186838 0.81 KDM4E (0.66) TSPOPSEN1PSEN2APH1BNCSTN

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070293558-A1 Ophthalmic Compositions for Treating Ocular Hypertension MERCK SHARP & DOHME CORP. 2007-12-20 US claimed
EP-1802299-A2 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION Merck & Co., Inc. (US) 2007-07-04 EP claimed
WO-2006044425-A2 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION MERCK & CO., INC. (US) 2006-04-27 WO claimed
US-20070293558-A1 Ophthalmic Compositions for Treating Ocular Hypertension MERCK SHARP & DOHME CORP. 2007-12-20 US disclosed
EP-1802299-A2 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION Merck & Co., Inc. (US) 2007-07-04 EP disclosed
WO-2006044425-A2 OPHTHALMIC COMPOSITIONS FOR TREATING OCULAR HYPERTENSION MERCK & CO., INC. (US) 2006-04-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070293558-A1 Ophthalmic Compositions for Treating Ocular Hypertension KCNH2, KCNJ11, KCNN1 TSPO 936/4885LMNA 351/4885HPGD 252/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.